Geometry & MOs

Info

ID:	11868
PubChem CID:	122083
Reduced:	O2N3C10H23 (1)
Stoich.:	A2B3C10D23 (1)
Weight, g/mol:	217.179027
ΔH_f, kcal/mol:	-110.62
Dipole, Da:	5.23
IP(EA), eV:	-9.07(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-6-(4-aminobutylamino)hexanoic acid

Drug info:

PubChemData

Smile

C(CCNCCCCN)C[C@@H](C(=O)O)N

DOS

IR

Vibrations